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Home > Encyclopedia > 3-(Cyclohexylamino)propanenitrile

3-(Cyclohexylamino)propanenitrile

3-(Cyclohexylamino)propanenitrile structure

3-(Cyclohexylamino)propanenitrile 

structure
  • CAS No:

    702-03-4

  • Formula:

    C9H16N2

  • Chemical Name:

    3-(Cyclohexylamino)propanenitrile

  • Synonyms:

    Propanenitrile,3-(cyclohexylamino)-;Propionitrile,3-(cyclohexylamino)-;3-(Cyclohexylamino)propanenitrile;N-(2-Cyanoethyl)cyclohexylamine;3-(Cyclohexylamino)propionitrile;N-(2-Cyanoethyl)-N-cyclohexylamine

3-(Cyclohexylamino)propanenitrile Basic Attributes

152.23700

152.24

211-864-5

DTXSID20220465

2926909090

Characteristics

35.82000

2.21328

0.94 g/cm3

122ºC

149-151 °C @ Press: 11 Torr

125.4ºC

1.474

Safety Information

UN 3276

R20/21/22

26-36/37/39

Xi

P260, P261, P264, P270, P271, P273, P280, P301+P310, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P363, P403+P233, P405, P501

H301

|Danger|H301 (52.05%): Toxic if swallowed [Danger Acute toxicity, oral]|P260, P261, P264, P270, P271, P273, P280, P301+P310, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 160 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:152.24
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:152.131348519
Monoisotopic Mass:152.131348519
Topological Polar Surface Area:35.8
Heavy Atom Count:11
Complexity:139
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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